3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Openeye Name: 3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-isobutyl-benzamide CAS Name: 3-[[[4-ethyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 3-[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Traditional Name: 3-[[[4-ethyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]-N-isobutyl-benzamide Formula: C22H32N4OS MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)CC)SCC2=CC=CC(=C2)C(=O)NCC(C)C

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)CC)SCC2=CC=CC(=C2)C(=O)NCC(C)C

InChI

InChI=1S/C22H32N4OS/c1-6-11-26(5)20-13-19(7-2)24-22(25-20)28-15-17-9-8-10-18(12-17)21(27)23-14-16(3)4/h8-10,12-13,16H,6-7,11,14-15H2,1-5H3,(H,23,27)